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CAS Number: 59040-84-5
methyl indoline-2-carboxylate

Structure

methyl indoline-2-carboxylate
Name: methyl indoline-2-carboxylate
Synonyms:
General Information
Product Number: 59040845
CAS Registry Number: 59040-84-5
Name:
        1H-​Indole-​2-​carboxylic acid, 2,​3-​dihydro-​, methyl ester
        2,​3-​Dihydroindole-​2-​carboxylic acid methyl ester; 2-​Methoxycarbonylindol​ine; Indoline-​2-​carboxylic acid methyl ester; MO 00997; Methyl indoline-​2-​carboxylate 
        Deleted CAS Registry Numbers: 130791-​93-​4
 
Chemical Formula: C10H11NO2
Exact Mass: 177.08
Molecular Weight: 177.20
m/z: 177.08 (100.0%), 178.08 (11.3%)
Elemental Analysis: C, 67.78; H, 6.26; N, 7.90; O, 18.06
 
InChI: InChI=1S/C10H11NO2/c1-13-10(12)9-6-7-4-2-3-5-8(7)11-9/h2-5,9,11H,6H2,1H3
InChIKey: URORFKDEPJFPOV-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1CC2=CC=CC=C2N1

Specification

98%

References
  1. (1) Alatorre-Santamaria, Sergio; Tetrahedron: Asymmetry 2008, V19(14), P1714-1719 CAPLUS
  2. (2) Jorgensen, Malene R.; Journal of Medicinal Chemistry 2005, V48(1), P56-70 CAPLUS
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